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(6aS,11aS)-3,9-dimethoxy-6,11a-dihydro-[1]benzofuro[3,2-c]chromen-6a-ol

HCID 627142
NotesReactions
Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3187-52-8
Standard SMILES
COc1ccc2c(c1)OCC1(O)c3ccc(OC)cc3OC21
InChIKey
VVPGAJNPGZZNBM-UHFFFAOYSA-N
Molecular formula
C17H16O5
Average molar mass
300.3 g/mol
Monoisotopic mass
300.09977361

Overview

CID 44428627 has been reported in Ononis viscosa and Sophora flavescens with data available.

Names & identifiers

Preferred name
(6aS,11aS)-3,9-dimethoxy-6,11a-dihydro-[1]benzofuro[3,2-c]chromen-6a-ol
IUPAC
3,9-dimethoxy-6,11a-dihydro-[1]benzofuro[3,2-c]chromen-6a-ol
English name
variabilin
Molecular formula
C17H16O5
Molecular weight
300.31

Names & synonyms

Variabilin?(6aS,11aS)-3,9-dimethoxy-6,11a-dihydro-[1]benzofuro[3,2-c]chromen-6a-olCID 44428627orb1991670SCHEMBL13743175VVPGAJNPGZZNBM-UHFFFAOYSA-NAKOS040735078T125054B0005-4583013,9-Dimethoxy-6H-[1]benzofuro[3,2-c]chromen-6a(11ah)-ol #6H-Benzofuro[3,2-c][1]benzopyran-6a(11aH)-ol, 3,9-dimethoxy-, (6aR-cis)-variabilin
Show more names
Homopisatin(+)-HomopisatinVariabilin(Dalbergia)(6aR)-3,9-Dimethoxy-6H-benzofuro[3,2-c][1]benzopyran-6aβ(11aβH)-ol6H-Benzofuro[3,2-c][1]benzopyran-6a(11aH)-ol, 3,9-dimethoxy-, (6aR,11aR)-

Database identifiers

CAS
3187-52-8
PubChem CID
627142
Nikkaji
J2.916.777J

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
57.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
22
Formal charge
0
Complexity
416

Chemistry & industry

Pharmacology

Cellular LocationsMembrane
Applications · 1 item

UsesVariabilin (Homopisatin) is a potent RGD-containing antagonist of glycoprotein IIb-IIIa and platelet aggregation inhibitor from the hard tick Dermacentor variabilis. Variabilin potently inhibits platelet aggregation induced by the platelet agonists ADP, collagen, and thrombin receptor peptide SFLLRNP. Variabilin also blocks platelet adhesion to immobilized Fg. In addition, Variabilin inhibits binding of purified human GPIIb-IIIa to immobilized Fg[1][2].

Suppliers2 total

上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]

Additional notes

DefinitionChEBI: (-)-Variabilin is a member of pterocarpans.

Related reactions

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Compound notes

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